3-(4-decoxyphenyl)isochromen-1-one

Systemtic Name: 3-(4-decoxyphenyl)isochromen-1-one Openeye Name: 3-(4-decoxyphenyl)isochromen-1-one CAS Name: 3-(4-decoxyphenyl)-2-benzopyran-1-one IUPAC Name: 3-(4-decoxyphenyl)isochromen-1-one Traditional Name: 3-(4-decoxyphenyl)isocoumarin Formula: C25H30O3 MolecularWeight: 378.5039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=O)O2

Isomeric SMILES

CCCCCCCCCCOC1=CC=C(C=C1)C2=CC3=CC=CC=C3C(=O)O2

InChI

InChI=1S/C25H30O3/c1-2-3-4-5-6-7-8-11-18-27-22-16-14-20(15-17-22)24-19-21-12-9-10-13-23(21)25(26)28-24/h9-10,12-17,19H,2-8,11,18H2,1H3